| CAS Number | 1258863-98-7 |
| Catalog Number | AG01BS3T(AGN-PC-0WBERC) |
| Chemical Name | 1-(2-fluoroethyl)-1H-pyrazol-3-amine |
| IUPAC Name | 1-(2-fluoroethyl)pyrazol-3-amine |
| InChI | InChI=1S/C5H8FN3/c6-2-4-9-3-1-5(7)8-9/h1,3H,2,4H2,(H2,7,8) |
| InChI Key | MWSMIKDDSZIQEU-UHFFFAOYSA-N |
| MDL Number | MFCD23130701 |
| Molecular Formula | C5H8FN3 |
| Molecular Weight | 129.1355 |
| SMILES | NC1=NN(CCF)C=C1 |
| Synonyms | 1258863-98-7,
1-(2-fluoroethyl)-1H-pyrazol-3-amine,
SCHEMBL16943120,
ZINC87775426,
AKOS019264903,
1-(2-Fluoro-ethyl)-1H-pyrazol-3-ylamine,
|
| Complexity | 88.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.138g/mol |
| Monoisotopic Mass | 129.07g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number